$cell vectors 1.0 4.3609979479673342 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.7799925748508532 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.7199954263339876 8 2 12 Direct 0.0000000000000000 0.0000000000000000 0.0251000000000002 # Pb1 0.0000000000000000 0.4999999999999998 0.0000000000000000 # Pb2 0.0000000000000000 0.2377000000000002 0.7826999999999998 # Pb3 0.5000000000000000 0.5000000000000001 0.5251000000000001 # Pb4 0.5000000000000000 0.0000000000000000 0.5000000000000000 # Pb5 0.5000000000000000 0.7376999999999999 0.2826999999999997 # Pb6 0.0000000000000000 0.7622999999999999 0.7826999999999998 # Pb7 0.5000000000000000 0.2623000000000000 0.2826999999999997 # Pb8 0.0000000000000000 0.0000000000000000 0.7047999999999996 # Se1 0.5000000000000000 0.4999999999999998 0.2048000000000002 # Se2 0.0000000000000000 0.1137999999999999 0.2981999999999997 # Br1 0.0000000000000000 0.3662999999999998 0.4660999999999997 # Br2 0.0000000000000000 0.3149000000000001 0.0783999999999999 # Br3 0.5000000000000000 0.6137999999999998 0.7981999999999997 # Br4 0.5000000000000000 0.8663000000000004 0.9660999999999998 # Br5 0.5000000000000000 0.8148999999999998 0.5783999999999999 # Br6 0.0000000000000000 0.8862000000000000 0.2981999999999997 # Br7 0.0000000000000000 0.6337000000000000 0.4660999999999997 # Br8 0.0000000000000000 0.6850999999999999 0.0783999999999999 # Br9 0.5000000000000000 0.3861999999999999 0.7981999999999997 # Br10 0.5000000000000000 0.1336999999999999 0.9660999999999998 # Br11 0.5000000000000000 0.1851000000000001 0.5783999999999999 # Br12